Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

4-Chloro-6-(1H-imidazol-1-yl)pyrimidine

Related Products

Hot Products

Basic Information Post buying leads Suppliers
Name

4-Chloro-6-(1H-imidazol-1-yl)pyrimidine

EINECS N/A
CAS No. 114834-02-5 Density 1.475 g/cm3
PSA 43.60000 LogP 1.31570
Solubility N/A Melting Point 131.5-132.0 °C
Formula C7H5ClN4 Boiling Point 371.192 °C at 760 mmHg
Molecular Weight 180.596 Flash Point 178.291 °C
Transport Information N/A Appearance Yellow power
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 114834-02-5 (4-Chloro-6-(1H-imidazol-1-yl)pyrimidine) Hazard Symbols N/A
Synonyms

4-Chloro-6-(1H-imidazol-1-yl)pyrimidine;Pyrimidine, 4-chloro-6-(1H-imidazol-1-yl)-;4-Chloro-6-imidazol-1-yl-pyrimidine;

 

4-Chloro-6-(1H-imidazol-1-yl)pyrimidine Specification

The 4-Chloro-6-(1H-imidazol-1-yl)pyrimidine, with the CAS registry number 114834-02-5, is also called 4-Chloro-6-imidazol-1-yl-pyrimidine. And the molecular formula of the chemical is C7H5ClN4.

The characteristics of this chemical are as followings: (1)ACD/LogP: 0.23; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.23; (4)ACD/LogD (pH 7.4): 0.23; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 31.72; (8)ACD/KOC (pH 7.4): 31.84; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 43.6 Å2; (13)Index of Refraction: 1.702; (14)Molar Refractivity: 47.42 cm3; (15)Molar Volume: 122.3 cm3; (16)Polarizability: 18.79×10-24cm3; (17)Surface Tension: 57.6 dyne/cm; (18)Density: 1.47 g/cm3; (19)Flash Point: 178.3 °C; (20)Enthalpy of Vaporization: 59.39 kJ/mol; (21)Boiling Point: 371.2 °C at 760 mmHg; (22)Vapour Pressure: 2.24E-05 mmHg at 25°C.

Uses of 4-Chloro-6-(1H-imidazol-1-yl)pyrimidine: It can react with pyrrolidine to produce 4-imidazol-1-yl-6-pyrrolidin-1-yl-pyrimidine. This reaction will need menstruum acetone. The reaction time is 0.5 hours with heating, and the yield is about 70%. 

 

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Clc1ncnc(c1)n2ccnc2
(2)InChI: InChI=1/C7H5ClN4/c8-6-3-7(11-4-10-6)12-2-1-9-5-12/h1-5H
(3)InChIKey: BOBHIPMYQAROLL-UHFFFAOYAY

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 114834-02-5